Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.66 |
| ▸ | TSHR | P16473 | 7/20 | 0.66 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.66 |
| ▸ | MEN1 | O00255 | 4/20 | 0.66 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.66 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.66 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.66 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.66 |
| ▸ | LMNA | P02545 | 2/20 | 0.66 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.60 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.60 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.60 |
| ▸ | GAA | P10253 | 2/20 | 0.57 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | GFER | P55789 | 1/20 | 0.51 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL8701406 | 0.90 | KMT2A (0.64) | ALDH1A1TSHRKMT2AMEN1CYP1A2 | |
| SCHEMBL8704636 | 0.87 | KMT2A (0.57) | ALDH1A1TSHRKMT2AMEN1CYP1A2 | |
| SCHEMBL8701044 | 0.84 | KMT2A (0.65) | ALDH1A1TSHRKMT2AMEN1CYP1A2 | |
| SCHEMBL8700078 | 0.81 | MAPT (0.56) | ALDH1A1TSHRKMT2AMEN1NPSR1 | |
| SCHEMBL8699355 | 0.80 | CHRM4 (0.45) | ALDH1A1TSHRKMT2AMEN1CYP1A2 | |
| SCHEMBL8702850 | 0.79 | PANK3 (0.56) | ALDH1A1TSHRKMT2AMEN1NPSR1 | |
| SCHEMBL8699098 | 0.77 | PANK3 (0.54) | ALDH1A1TSHRKMT2AMEN1CYP1A2 | |
| SCHEMBL8705064 | 0.77 | HTR1A (0.52) | ALDH1A1TSHRKMT2ANPSR1LMNA | |
| SCHEMBL8699470 | 0.76 | KMT2A (0.51) | ALDH1A1TSHRKMT2AMEN1LMNA | |
| SCHEMBL8700940 | 0.76 | RBP4 (0.61) | ALDH1A1KMT2AMEN1NPSR1LMNA |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5780472-A | ANTITUMOR AGENTS | SAMJIN PHARMACEUTICAZL CO., LTD. (KR) | 1998-07-14 | — | — | US | disclosed |
| WO-1996021648-A1 | NEW PIPERAZINE DERIVATIVES AND METHODS FOR THE PREPARATION THEREOF AND COMPOSITIONS CONTAINING THE SAME | SAMJIN PHARMACEUTICAL CO., LTD. (KR) | 1996-07-18 | — | — | WO | disclosed |